SCHEMBL2498989

SCHEMBL2498989

COC(=O)C(O)[C@H](N)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
LTA4H P09960 1/20 0.35
CA14 Q9ULX7 2/20 0.34
CA12 O43570 1/20 0.32
KMT2A Q03164 1/20 0.32
HIF1A Q16665 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
SLC7A5 Q01650 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2498988 1.00 SMN1; SMN2 (0.40) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H
SCHEMBL12069779 1.00 SMN1; SMN2 (0.40) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H
SCHEMBL16238395 1.00 SMN1; SMN2 (0.40) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H
Hydrochloric Acid SCHEMBL16238384 0.97 SMN1; SMN2 (0.39) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H
Hydrochloric Acid SCHEMBL10858237 0.97 SMN1; SMN2 (0.39) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H
Hydrochloric Acid SCHEMBL28171243 0.97 SMN1; SMN2 (0.39) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H
Hydrochloric Acid SCHEMBL16238696 0.97 SMN1; SMN2 (0.39) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H
SCHEMBL4114625 0.85 SLC1A1 (0.48) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H
SCHEMBL9782083 0.85 SLC1A1 (0.48) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H
SCHEMBL11004061 0.85 SLC1A1 (0.43) SMN1; SMN2SLC1A3SLC1A2SLC1A1LTA4H

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030513-B2 Rheology control agents E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-10-04 US disclosed
US-20100204376-A1 Rheology Control Agents AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) 2010-08-12 US disclosed
US-7741510-B2 Rheology control agents E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-06-22 US disclosed
CN-101137692-A Coating compositions containing rheology control agents DU PONT (US) 2008-03-05 CN disclosed
EP-1838749-A1 COATING COMPOSITIONS CONTAINING RHEOLOGY CONTROL AGENTS E.I.Du pont de nemours and company (US) 2007-10-03 EP disclosed
WO-2006076715-A1 COATING COMPOSITIONS CONTAINING RHEOLOGY CONTROL AGENTS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2006-07-20 WO disclosed
US-20060155021-A1 Coating compositions containing rheology control agents E. I. DU PONT DE NEMOURS AND COMPANY 2006-07-13 US disclosed
US-20060155146-A1 Rheology control agents AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) 2006-07-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060155146-A1 Rheology control agents HCRTR1, HCRTR2, REL SMN1; SMN2 3722/4885SLC1A3 3491/4885SLC1A2 4296/4885
US-20100204376-A1 Rheology Control Agents HCRTR1, HCRTR2, REL SMN1; SMN2 3722/4885SLC1A3 3491/4885SLC1A2 4296/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.